sodium 4-[(E)-3-(4-dimethylaminophenyl)prop-2-enoyl]-8-methyl-naphthalene-1-carboxylate

Systemtic Name: sodium 4-[(E)-3-(4-dimethylaminophenyl)prop-2-enoyl]-8-methyl-naphthalene-1-carboxylate Openeye Name: sodium 4-[(E)-3-(4-dimethylaminophenyl)prop-2-enoyl]-8-methyl-naphthalene-1-carboxylate CAS Name: sodium 4-[(E)-3-(4-dimethylaminophenyl)-1-oxoprop-2-enyl]-8-methyl-1-naphthalenecarboxylate IUPAC Name: sodium 4-[(E)-3-(4-dimethylaminophenyl)prop-2-enoyl]-8-methylnaphthalene-1-carboxylate Traditional Name: sodium 4-[(E)-3-(4-dimethylaminophenyl)acryloyl]-8-methyl-1-naphthoate Formula: C23H20NNaO3 MolecularWeight: 381.39957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C=CC(=C12)C(=O)[O-])C(=O)C=CC3=CC=C(C=C3)N(C)C.[Na+]

Isomeric SMILES

CC1=CC=CC2=C(C=CC(=C12)C(=O)[O-])C(=O)/C=C/C3=CC=C(C=C3)N(C)C.[Na+]

InChI

InChI=1S/C23H21NO3.Na/c1-15-5-4-6-19-18(12-13-20(22(15)19)23(26)27)21(25)14-9-16-7-10-17(11-8-16)24(2)3;/h4-14H,1-3H3,(H,26,27);/q;+1/p-1/b14-9+;