[2-[(3-cyano-1-phenyl-propyl)amino]-2-oxidanylidene-ethyl] 4-[(4-methyl-2-oxidanylidene-chromen-7-yl)oxymethyl]benzoate

Systemtic Name: [2-[(3-cyano-1-phenyl-propyl)amino]-2-oxidanylidene-ethyl] 4-[(4-methyl-2-oxidanylidene-chromen-7-yl)oxymethyl]benzoate Openeye Name: [2-[(3-cyano-1-phenyl-propyl)amino]-2-oxo-ethyl] 4-[(4-methyl-2-oxo-chromen-7-yl)oxymethyl]benzoate CAS Name: 4-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxymethyl]benzoic acid [2-[(3-cyano-1-phenylpropyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyano-1-phenylpropyl)amino]-2-oxoethyl] 4-[(4-methyl-2-oxochromen-7-yl)oxymethyl]benzoate Traditional Name: 4-[(2-keto-4-methyl-chromen-7-yl)oxymethyl]benzoic acid [2-[(3-cyano-1-phenyl-propyl)amino]-2-keto-ethyl] ester Formula: C30H26N2O6 MolecularWeight: 510.53724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(=O)OCC(=O)NC(CCC#N)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(=O)OCC(=O)NC(CCC#N)C4=CC=CC=C4

InChI

InChI=1S/C30H26N2O6/c1-20-16-29(34)38-27-17-24(13-14-25(20)27)36-18-21-9-11-23(12-10-21)30(35)37-19-28(33)32-26(8-5-15-31)22-6-3-2-4-7-22/h2-4,6-7,9-14,16-17,26H,5,8,18-19H2,1H3,(H,32,33)