methyl 6-[5,6-dimethoxy-3-[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-4-yl]indol-1-yl]-6-oxidanylidene-hex-2-ynoate

Systemtic Name: methyl 6-[5,6-dimethoxy-3-[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-4-yl]indol-1-yl]-6-oxidanylidene-hex-2-ynoate Openeye Name: methyl 6-[3-(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)-5,6-dimethoxy-indol-1-yl]-6-oxo-hex-2-ynoate CAS Name: 6-[5,6-dimethoxy-3-[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-4-yl]-1-indolyl]-6-oxo-2-hexynoic acid methyl ester IUPAC Name: methyl 6-[3-(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)-5,6-dimethoxyindol-1-yl]-6-oxohex-2-ynoate Traditional Name: 6-[3-(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)-5,6-dimethoxy-indol-1-yl]-6-keto-hex-2-ynoic acid methyl ester Formula: C29H30N2O5 MolecularWeight: 486.5589

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CN2C(=O)CCC#CC(=O)OC)C3=CCN(CC3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CN2C(=O)CCC#CC(=O)OC)C3=CCN(CC3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C29H30N2O5/c1-34-26-17-23-24(22-13-15-30(16-14-22)19-21-9-5-4-6-10-21)20-31(25(23)18-27(26)35-2)28(32)11-7-8-12-29(33)36-3/h4-6,9-10,13,17-18,20H,7,11,14-16,19H2,1-3H3