ethyl 1-[[1-(2-azanyl-2-oxidanylidene-ethyl)indol-3-yl]methyl]-4-(cyclopropylmethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[1-(2-azanyl-2-oxidanylidene-ethyl)indol-3-yl]methyl]-4-(cyclopropylmethyl)piperidine-4-carboxylate Openeye Name: ethyl 1-[[1-(2-amino-2-oxo-ethyl)indol-3-yl]methyl]-4-(cyclopropylmethyl)piperidine-4-carboxylate CAS Name: 1-[[1-(2-amino-2-oxoethyl)-3-indolyl]methyl]-4-(cyclopropylmethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[1-(2-amino-2-oxoethyl)indol-3-yl]methyl]-4-(cyclopropylmethyl)piperidine-4-carboxylate Traditional Name: 1-[[1-(2-amino-2-keto-ethyl)indol-3-yl]methyl]-4-(cyclopropylmethyl)isonipecotic acid ethyl ester Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=CN(C3=CC=CC=C32)CC(=O)N)CC4CC4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=CN(C3=CC=CC=C32)CC(=O)N)CC4CC4

InChI

InChI=1S/C23H31N3O3/c1-2-29-22(28)23(13-17-7-8-17)9-11-25(12-10-23)14-18-15-26(16-21(24)27)20-6-4-3-5-19(18)20/h3-6,15,17H,2,7-14,16H2,1H3,(H2,24,27)