2-azanyl-1-(4-nitrophenyl)propane-1,3-diol; 2-naphthalen-2-ylethanoic acid

Systemtic Name: 2-azanyl-1-(4-nitrophenyl)propane-1,3-diol; 2-naphthalen-2-ylethanoic acid Openeye Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-(2-naphthyl)acetic acid CAS Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-(2-naphthalenyl)acetic acid IUPAC Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-naphthalen-2-ylacetic acid Traditional Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-(2-naphthyl)acetic acid Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC(=O)O.C1=CC(=CC=C1C(C(CO)N)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CC(=O)O.C1=CC(=CC=C1C(C(CO)N)O)[N+](=O)[O-]

InChI

InChI=1S/C12H10O2.C9H12N2O4/c13-12(14)8-9-5-6-10-3-1-2-4-11(10)7-9;10-8(5-12)9(13)6-1-3-7(4-2-6)11(14)15/h1-7H,8H2,(H,13,14);1-4,8-9,12-13H,5,10H2