ethyl 4-[[2-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[2-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[allyl-[2-[benzyl-[(6-methyl-4-oxo-chromen-3-yl)methyl]amino]-2-oxo-ethyl]amino]-4-oxo-butanoate CAS Name: 4-[[2-[(6-methyl-4-oxo-1-benzopyran-3-yl)methyl-(phenylmethyl)amino]-2-oxoethyl]-prop-2-enylamino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[benzyl-[(6-methyl-4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]-prop-2-enylamino]-4-oxobutanoate Traditional Name: 4-[allyl-[2-[benzyl-[(4-keto-6-methyl-chromen-3-yl)methyl]amino]-2-keto-ethyl]amino]-4-keto-butyric acid ethyl ester Formula: C29H32N2O6 MolecularWeight: 504.57418

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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=COC3=C(C2=O)C=C(C=C3)C

Isomeric SMILES

CCOC(=O)CCC(=O)N(CC=C)CC(=O)N(CC1=CC=CC=C1)CC2=COC3=C(C2=O)C=C(C=C3)C

InChI

InChI=1S/C29H32N2O6/c1-4-15-30(26(32)13-14-28(34)36-5-2)19-27(33)31(17-22-9-7-6-8-10-22)18-23-20-37-25-12-11-21(3)16-24(25)29(23)35/h4,6-12,16,20H,1,5,13-15,17-19H2,2-3H3