N-[4-[2-(3-chloranyl-4-methyl-phenyl)ethyl]phenyl]-2-methoxy-5-nitro-aniline

Systemtic Name: N-[4-[2-(3-chloranyl-4-methyl-phenyl)ethyl]phenyl]-2-methoxy-5-nitro-aniline Openeye Name: N-[4-[2-(3-chloro-4-methyl-phenyl)ethyl]phenyl]-2-methoxy-5-nitro-aniline CAS Name: N-[4-[2-(3-chloro-4-methylphenyl)ethyl]phenyl]-2-methoxy-5-nitroaniline IUPAC Name: N-[4-[2-(3-chloro-4-methylphenyl)ethyl]phenyl]-2-methoxy-5-nitroaniline Traditional Name: [4-[2-(3-chloro-4-methyl-phenyl)ethyl]phenyl]-(2-methoxy-5-nitro-phenyl)amine Formula: C22H21ClN2O3 MolecularWeight: 396.86674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC2=CC=C(C=C2)NC3=C(C=CC(=C3)[N+](=O)[O-])OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCC2=CC=C(C=C2)NC3=C(C=CC(=C3)[N+](=O)[O-])OC)Cl

InChI

InChI=1S/C22H21ClN2O3/c1-15-3-4-17(13-20(15)23)6-5-16-7-9-18(10-8-16)24-21-14-19(25(26)27)11-12-22(21)28-2/h3-4,7-14,24H,5-6H2,1-2H3