N-[(3-nitrophenyl)-(2-oxidanylnaphthalen-1-yl)methyl]butanamide

Systemtic Name: N-[(3-nitrophenyl)-(2-oxidanylnaphthalen-1-yl)methyl]butanamide Openeye Name: N-[(2-hydroxy-1-naphthyl)-(3-nitrophenyl)methyl]butanamide CAS Name: N-[(2-hydroxy-1-naphthalenyl)-(3-nitrophenyl)methyl]butanamide IUPAC Name: N-[(2-hydroxynaphthalen-1-yl)-(3-nitrophenyl)methyl]butanamide Traditional Name: N-[(2-hydroxy-1-naphthyl)-(3-nitrophenyl)methyl]butyramide Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(C1=CC(=CC=C1)[N+](=O)[O-])C2=C(C=CC3=CC=CC=C32)O

Isomeric SMILES

CCCC(=O)NC(C1=CC(=CC=C1)[N+](=O)[O-])C2=C(C=CC3=CC=CC=C32)O

InChI

InChI=1S/C21H20N2O4/c1-2-6-19(25)22-21(15-8-5-9-16(13-15)23(26)27)20-17-10-4-3-7-14(17)11-12-18(20)24/h3-5,7-13,21,24H,2,6H2,1H3,(H,22,25)