cyclopentylmethyl 2-[2-[[2-[(4-cyanophenyl)methyl]-1-methyl-indol-5-yl]amino]-2-oxidanylidene-ethoxy]ethanoate

Systemtic Name: cyclopentylmethyl 2-[2-[[2-[(4-cyanophenyl)methyl]-1-methyl-indol-5-yl]amino]-2-oxidanylidene-ethoxy]ethanoate Openeye Name: cyclopentylmethyl 2-[2-[[2-[(4-cyanophenyl)methyl]-1-methyl-indol-5-yl]amino]-2-oxo-ethoxy]acetate CAS Name: 2-[2-[[2-[(4-cyanophenyl)methyl]-1-methyl-5-indolyl]amino]-2-oxoethoxy]acetic acid cyclopentylmethyl ester IUPAC Name: cyclopentylmethyl 2-[2-[[2-[(4-cyanophenyl)methyl]-1-methylindol-5-yl]amino]-2-oxoethoxy]acetate Traditional Name: 2-[2-[[2-(4-cyanobenzyl)-1-methyl-indol-5-yl]amino]-2-keto-ethoxy]acetic acid cyclopentylmethyl ester Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)COCC(=O)OCC3CCCC3)C=C1CC4=CC=C(C=C4)C#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)COCC(=O)OCC3CCCC3)C=C1CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C27H29N3O4/c1-30-24(12-19-6-8-20(15-28)9-7-19)14-22-13-23(10-11-25(22)30)29-26(31)17-33-18-27(32)34-16-21-4-2-3-5-21/h6-11,13-14,21H,2-5,12,16-18H2,1H3,(H,29,31)