2-chloranyl-6-[(phenylmethyl)-propan-2-yl-amino]benzoic acid

Systemtic Name: 2-chloranyl-6-[(phenylmethyl)-propan-2-yl-amino]benzoic acid Openeye Name: 2-[benzyl(isopropyl)amino]-6-chloro-benzoic acid CAS Name: 2-chloro-6-[(phenylmethyl)-propan-2-ylamino]benzoic acid IUPAC Name: 2-[benzyl(propan-2-yl)amino]-6-chlorobenzoic acid Traditional Name: 2-[benzyl(isopropyl)amino]-6-chloro-benzoic acid Formula: C17H18ClNO2 MolecularWeight: 303.78332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C2=C(C(=CC=C2)Cl)C(=O)O

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C2=C(C(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C17H18ClNO2/c1-12(2)19(11-13-7-4-3-5-8-13)15-10-6-9-14(18)16(15)17(20)21/h3-10,12H,11H2,1-2H3,(H,20,21)