3-[(2-naphthalen-1-ylpropanoylamino)-phenyl-methyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[(2-naphthalen-1-ylpropanoylamino)-phenyl-methyl]thiophene-2-carboxylic acid Openeye Name: 3-[[2-(1-naphthyl)propanoylamino]-phenyl-methyl]thiophene-2-carboxylic acid CAS Name: 3-[[[2-(1-naphthalenyl)-1-oxopropyl]amino]-phenylmethyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[(2-naphthalen-1-ylpropanoylamino)-phenylmethyl]thiophene-2-carboxylic acid Traditional Name: 3-[[2-(1-naphthyl)propanoylamino]-phenyl-methyl]-2-thenoic acid Formula: C25H21NO3S MolecularWeight: 415.50414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC(C3=CC=CC=C3)C4=C(SC=C4)C(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC(C3=CC=CC=C3)C4=C(SC=C4)C(=O)O

InChI

InChI=1S/C25H21NO3S/c1-16(19-13-7-11-17-8-5-6-12-20(17)19)24(27)26-22(18-9-3-2-4-10-18)21-14-15-30-23(21)25(28)29/h2-16,22H,1H3,(H,26,27)(H,28,29)