(2,2,4-trimethyl-1H-quinolin-6-yl) (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: (2,2,4-trimethyl-1H-quinolin-6-yl) (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: (2,2,4-trimethyl-1H-quinolin-6-yl) (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid (2,2,4-trimethyl-1H-quinolin-6-yl) ester IUPAC Name: (2,2,4-trimethyl-1H-quinolin-6-yl) (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid (2,2,4-trimethyl-1H-quinolin-6-yl) ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC2=C1C=C(C=C2)OC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-])(C)C

Isomeric SMILES

CC1=CC(NC2=C1C=C(C=C2)OC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-])(C)C

InChI

InChI=1S/C21H20N2O4/c1-14-13-21(2,3)22-19-9-8-17(12-18(14)19)27-20(24)10-7-15-5-4-6-16(11-15)23(25)26/h4-13,22H,1-3H3/b10-7+