methyl (E)-2-cyano-3-(2-cyano-1-methyl-indol-3-yl)-3-[(3-ethoxy-3-oxidanylidene-propyl)amino]prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-(2-cyano-1-methyl-indol-3-yl)-3-[(3-ethoxy-3-oxidanylidene-propyl)amino]prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-(2-cyano-1-methyl-indol-3-yl)-3-[(3-ethoxy-3-oxo-propyl)amino]prop-2-enoate CAS Name: (E)-2-cyano-3-(2-cyano-1-methyl-3-indolyl)-3-[(3-ethoxy-3-oxopropyl)amino]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-(2-cyano-1-methylindol-3-yl)-3-[(3-ethoxy-3-oxopropyl)amino]prop-2-enoate Traditional Name: (E)-2-cyano-3-(2-cyano-1-methyl-indol-3-yl)-3-[(3-ethoxy-3-keto-propyl)amino]acrylic acid methyl ester Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=C(C#N)C(=O)OC)C1=C(N(C2=CC=CC=C21)C)C#N

Isomeric SMILES

CCOC(=O)CCN/C(=C(\C#N)/C(=O)OC)/C1=C(N(C2=CC=CC=C21)C)C#N

InChI

InChI=1S/C20H20N4O4/c1-4-28-17(25)9-10-23-19(14(11-21)20(26)27-3)18-13-7-5-6-8-15(13)24(2)16(18)12-22/h5-8,23H,4,9-10H2,1-3H3/b19-14+