ethyl 4-[2-[[4-(1-ethoxycarbonylcyclobutyl)oxy-7-methyl-quinolin-2-yl]carbonylamino]-5-oxidanylidene-5-propan-2-yloxy-pentanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[[4-(1-ethoxycarbonylcyclobutyl)oxy-7-methyl-quinolin-2-yl]carbonylamino]-5-oxidanylidene-5-propan-2-yloxy-pentanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[[4-(1-ethoxycarbonylcyclobutoxy)-7-methyl-quinoline-2-carbonyl]amino]-5-isopropoxy-5-oxo-pentanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[[[4-(1-ethoxycarbonylcyclobutyl)oxy-7-methyl-2-quinolinyl]-oxomethyl]amino]-1,5-dioxo-5-propan-2-yloxypentyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[4-(1-ethoxycarbonylcyclobutyl)oxy-7-methylquinoline-2-carbonyl]amino]-5-oxo-5-propan-2-yloxypentanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[4-(1-carbethoxycyclobutoxy)-7-methyl-quinoline-2-carbonyl]amino]-5-isopropoxy-5-keto-pentanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C33H44N4O9 MolecularWeight: 640.72386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC1)OC2=CC(=NC3=C2C=CC(=C3)C)C(=O)NC(CCC(=O)OC(C)C)C(=O)N4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CCC1)OC2=CC(=NC3=C2C=CC(=C3)C)C(=O)NC(CCC(=O)OC(C)C)C(=O)N4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C33H44N4O9/c1-6-43-31(41)33(13-8-14-33)46-27-20-26(34-25-19-22(5)9-10-23(25)27)29(39)35-24(11-12-28(38)45-21(3)4)30(40)36-15-17-37(18-16-36)32(42)44-7-2/h9-10,19-21,24H,6-8,11-18H2,1-5H3,(H,35,39)