ethyl 5-(2-dimethylaminoethyloxy)-2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate

Systemtic Name: ethyl 5-(2-dimethylaminoethyloxy)-2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate Openeye Name: ethyl 5-(2-dimethylaminoethyloxy)-2-[[(E)-3-(2-naphthyl)but-2-enoyl]amino]benzoate CAS Name: 5-(2-dimethylaminoethyloxy)-2-[[(E)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 5-(2-dimethylaminoethyloxy)-2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate Traditional Name: 5-(2-dimethylaminoethyloxy)-2-[[(E)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid ethyl ester Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)OCCN(C)C)NC(=O)C=C(C)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)OCCN(C)C)NC(=O)/C=C(\C)/C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C27H30N2O4/c1-5-32-27(31)24-18-23(33-15-14-29(3)4)12-13-25(24)28-26(30)16-19(2)21-11-10-20-8-6-7-9-22(20)17-21/h6-13,16-18H,5,14-15H2,1-4H3,(H,28,30)/b19-16+