ethyl 3-[4-azanylbutyl-(2-ethoxycarbonyl-4-phenyl-butyl)carbamoyl]-2,3-dihydro-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[4-azanylbutyl-(2-ethoxycarbonyl-4-phenyl-butyl)carbamoyl]-2,3-dihydro-1H-indole-2-carboxylate Openeye Name: ethyl 3-[4-aminobutyl-(2-ethoxycarbonyl-4-phenyl-butyl)carbamoyl]indoline-2-carboxylate CAS Name: 3-[[4-aminobutyl-(2-ethoxycarbonyl-4-phenylbutyl)amino]-oxomethyl]-2,3-dihydro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-aminobutyl-(2-ethoxycarbonyl-4-phenylbutyl)carbamoyl]-2,3-dihydro-1H-indole-2-carboxylate Traditional Name: 3-[4-aminobutyl-(2-carbethoxy-4-phenyl-butyl)carbamoyl]indoline-2-carboxylic acid ethyl ester Formula: C29H39N3O5 MolecularWeight: 509.63706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=CC=CC=C2N1)C(=O)N(CCCCN)CC(CCC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1C(C2=CC=CC=C2N1)C(=O)N(CCCCN)CC(CCC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C29H39N3O5/c1-3-36-28(34)22(17-16-21-12-6-5-7-13-21)20-32(19-11-10-18-30)27(33)25-23-14-8-9-15-24(23)31-26(25)29(35)37-4-2/h5-9,12-15,22,25-26,31H,3-4,10-11,16-20,30H2,1-2H3