ethyl 4-[[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[allyl-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]amino]-4-oxo-butanoate CAS Name: 4-[[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-prop-2-enylamino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-prop-2-enylamino]-4-oxobutanoate Traditional Name: 4-[allyl-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]amino]-4-keto-butyric acid ethyl ester Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(CC=C)CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C

Isomeric SMILES

CCOC(=O)CCC(=O)N(CC=C)CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C

InChI

InChI=1S/C24H31N3O4/c1-4-15-26(22(28)13-14-24(30)31-5-2)19-23(29)27(17-20-10-7-6-8-11-20)18-21-12-9-16-25(21)3/h4,6-12,16H,1,5,13-15,17-19H2,2-3H3