benzoic acid; (3R)-3-phenylbutan-2-amine

Systemtic Name: benzoic acid; (3R)-3-phenylbutan-2-amine Openeye Name: benzoic acid; (3R)-3-phenylbutan-2-amine CAS Name: benzoic acid; (3R)-3-phenyl-2-butanamine IUPAC Name: benzoic acid; (3R)-3-phenylbutan-2-amine Traditional Name: benzoic acid; [(2R)-1-methyl-2-phenyl-propyl]amine Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(C)N.C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

C[C@H](C1=CC=CC=C1)C(C)N.C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C10H15N.C7H6O2/c1-8(9(2)11)10-6-4-3-5-7-10;8-7(9)6-4-2-1-3-5-6/h3-9H,11H2,1-2H3;1-5H,(H,8,9)/t8-,9?;/m0./s1