azane; 4-phenylbenzaldehyde; 2-phenylethanoic acid

Systemtic Name: azane; 4-phenylbenzaldehyde; 2-phenylethanoic acid Openeye Name: ammonia; 2-phenylacetic acid; 4-phenylbenzaldehyde CAS Name: ammonia; 2-phenylacetic acid; 4-phenylbenzaldehyde IUPAC Name: azane; 2-phenylacetic acid; 4-phenylbenzaldehyde Traditional Name: ammonia; 2-phenylacetic acid; 4-phenylbenzaldehyde Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)O.C1=CC=C(C=C1)C2=CC=C(C=C2)C=O.N

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)O.C1=CC=C(C=C1)C2=CC=C(C=C2)C=O.N

InChI

InChI=1S/C13H10O.C8H8O2.H3N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12;9-8(10)6-7-4-2-1-3-5-7;/h1-10H;1-5H,6H2,(H,9,10);1H3