2-[2-nitro-4-[(phenylmethyl)amino]naphthalen-1-yl]ethyl ethanoate

Systemtic Name: 2-[2-nitro-4-[(phenylmethyl)amino]naphthalen-1-yl]ethyl ethanoate Openeye Name: 2-[4-(benzylamino)-2-nitro-1-naphthyl]ethyl acetate CAS Name: acetic acid 2-[2-nitro-4-[(phenylmethyl)amino]-1-naphthalenyl]ethyl ester IUPAC Name: 2-[4-(benzylamino)-2-nitronaphthalen-1-yl]ethyl acetate Traditional Name: acetic acid 2-[4-(benzylamino)-2-nitro-1-naphthyl]ethyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC1=C(C=C(C2=CC=CC=C21)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCC1=C(C=C(C2=CC=CC=C21)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O4/c1-15(24)27-12-11-19-17-9-5-6-10-18(17)20(13-21(19)23(25)26)22-14-16-7-3-2-4-8-16/h2-10,13,22H,11-12,14H2,1H3