methyl 1-[2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-[cyclopentyl(piperonyl)amino]-2-keto-ethyl]indole-3-carboxylic acid methyl ester Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N(CC3=CC4=C(C=C3)OCO4)C5CCCC5

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N(CC3=CC4=C(C=C3)OCO4)C5CCCC5

InChI

InChI=1S/C25H26N2O5/c1-30-25(29)20-14-26(21-9-5-4-8-19(20)21)15-24(28)27(18-6-2-3-7-18)13-17-10-11-22-23(12-17)32-16-31-22/h4-5,8-12,14,18H,2-3,6-7,13,15-16H2,1H3