methyl 2-[[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-yl]carbonylamino]-3-methyl-butanoate Openeye Name: methyl 2-[[4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-carbonyl]amino]-3-methyl-butanoate CAS Name: 2-[[[4-[3-(1H-indol-3-yl)-1-oxopropyl]-1-piperazinyl]-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-carbonyl]amino]-3-methylbutanoate Traditional Name: 2-[[4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-carbonyl]amino]-3-methyl-butyric acid methyl ester Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)N1CCN(CC1)C(=O)CCC2=CNC3=CC=CC=C32

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)N1CCN(CC1)C(=O)CCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C22H30N4O4/c1-15(2)20(21(28)30-3)24-22(29)26-12-10-25(11-13-26)19(27)9-8-16-14-23-18-7-5-4-6-17(16)18/h4-7,14-15,20,23H,8-13H2,1-3H3,(H,24,29)