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4-[(5,5,8-trimethyl-6H-naphthalen-2-yl)carbamoyl]benzoic acid

4-[(5,5,8-trimethyl-6H-naphthalen-2-yl)carbamoyl]benzoic acid

Systemtic Name:4-[(5,5,8-trimethyl-6H-naphthalen-2-yl)carbamoyl]benzoic acid
Openeye Name:4-[(5,5,8-trimethyl-6H-naphthalen-2-yl)carbamoyl]benzoic acid
CAS Name:4-[oxo-[(5,5,8-trimethyl-6H-naphthalen-2-yl)amino]methyl]benzoic acid
IUPAC Name:4-[(5,5,8-trimethyl-6H-naphthalen-2-yl)carbamoyl]benzoic acid
Traditional Name:4-[(5,5,8-trimethyl-6H-naphthalen-2-yl)carbamoyl]benzoic acid
Formula: C21H21NO3
MolecularWeight: 335.39634
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C2=C1C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)O)(C)C


Isomeric SMILES

CC1=CCC(C2=C1C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)O)(C)C


InChI

InChI=1S/C21H21NO3/c1-13-10-11-21(2,3)18-9-8-16(12-17(13)18)22-19(23)14-4-6-15(7-5-14)20(24)25/h4-10,12H,11H2,1-3H3,(H,22,23)(H,24,25)


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