ethyl (E)-3-[4-[(4-nitrophenyl)methylamino]-2-oxidanylidene-chromen-3-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[(4-nitrophenyl)methylamino]-2-oxidanylidene-chromen-3-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[(4-nitrophenyl)methylamino]-2-oxo-chromen-3-yl]prop-2-enoate CAS Name: (E)-3-[4-[(4-nitrophenyl)methylamino]-2-oxo-1-benzopyran-3-yl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[(4-nitrophenyl)methylamino]-2-oxochromen-3-yl]prop-2-enoate Traditional Name: (E)-3-[2-keto-4-[(4-nitrobenzyl)amino]chromen-3-yl]acrylic acid ethyl ester Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C2=CC=CC=C2OC1=O)NCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C2=CC=CC=C2OC1=O)NCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O6/c1-2-28-19(24)12-11-17-20(16-5-3-4-6-18(16)29-21(17)25)22-13-14-7-9-15(10-8-14)23(26)27/h3-12,22H,2,13H2,1H3/b12-11+