diethyl 2-[[2-oxidanylidene-4-[(phenylmethyl)-prop-2-enyl-amino]chromen-3-yl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[2-oxidanylidene-4-[(phenylmethyl)-prop-2-enyl-amino]chromen-3-yl]methylidene]propanedioate Openeye Name: diethyl 2-[[4-[allyl(benzyl)amino]-2-oxo-chromen-3-yl]methylene]propanedioate CAS Name: 2-[[2-oxo-4-[(phenylmethyl)-prop-2-enylamino]-1-benzopyran-3-yl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-[benzyl(prop-2-enyl)amino]-2-oxochromen-3-yl]methylidene]propanedioate Traditional Name: 2-[[4-[allyl(benzyl)amino]-2-keto-chromen-3-yl]methylene]malonic acid diethyl ester Formula: C27H27NO6 MolecularWeight: 461.50638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(C2=CC=CC=C2OC1=O)N(CC=C)CC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CC1=C(C2=CC=CC=C2OC1=O)N(CC=C)CC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C27H27NO6/c1-4-16-28(18-19-12-8-7-9-13-19)24-20-14-10-11-15-23(20)34-27(31)21(24)17-22(25(29)32-5-2)26(30)33-6-3/h4,7-15,17H,1,5-6,16,18H2,2-3H3