4-(ethylaminomethyl)-2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid

Systemtic Name: 4-(ethylaminomethyl)-2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid Openeye Name: 4-(ethylaminomethyl)-2-[[(E)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid CAS Name: 4-(ethylaminomethyl)-2-[[(E)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid IUPAC Name: 4-(ethylaminomethyl)-2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid Traditional Name: 4-(ethylaminomethyl)-2-[[(E)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC(=C(C=C1)C(=O)O)NC(=O)C=C(C)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCNCC1=CC(=C(C=C1)C(=O)O)NC(=O)/C=C(\C)/C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C24H24N2O3/c1-3-25-15-17-8-11-21(24(28)29)22(13-17)26-23(27)12-16(2)19-10-9-18-6-4-5-7-20(18)14-19/h4-14,25H,3,15H2,1-2H3,(H,26,27)(H,28,29)/b16-12+