ethyl (Z)-3-[[(E)-1-[(3-bromophenyl)amino]-3-methoxy-3-oxidanylidene-prop-1-en-2-yl]amino]-2-pyridin-2-yl-prop-2-enoate

Systemtic Name: ethyl (Z)-3-[[(E)-1-[(3-bromophenyl)amino]-3-methoxy-3-oxidanylidene-prop-1-en-2-yl]amino]-2-pyridin-2-yl-prop-2-enoate Openeye Name: ethyl (Z)-3-[[(E)-2-(3-bromoanilino)-1-methoxycarbonyl-vinyl]amino]-2-(2-pyridyl)prop-2-enoate CAS Name: (Z)-3-[[(E)-1-(3-bromoanilino)-3-methoxy-3-oxoprop-1-en-2-yl]amino]-2-(2-pyridinyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-[[(E)-1-(3-bromoanilino)-3-methoxy-3-oxoprop-1-en-2-yl]amino]-2-pyridin-2-ylprop-2-enoate Traditional Name: (Z)-3-[[(E)-2-(3-bromoanilino)-1-carbomethoxy-vinyl]amino]-2-(2-pyridyl)acrylic acid ethyl ester Formula: C20H20BrN3O4 MolecularWeight: 446.2945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC(=CNC1=CC(=CC=C1)Br)C(=O)OC)C2=CC=CC=N2

Isomeric SMILES

CCOC(=O)/C(=C\N/C(=C/NC1=CC(=CC=C1)Br)/C(=O)OC)/C2=CC=CC=N2

InChI

InChI=1S/C20H20BrN3O4/c1-3-28-19(25)16(17-9-4-5-10-22-17)12-24-18(20(26)27-2)13-23-15-8-6-7-14(21)11-15/h4-13,23-24H,3H2,1-2H3/b16-12-,18-13+