2-[2-chloranyl-1-[3,5-dimethyl-4-[(2-nitrophenyl)methoxy]phenyl]ethyl]guanidine

Systemtic Name: 2-[2-chloranyl-1-[3,5-dimethyl-4-[(2-nitrophenyl)methoxy]phenyl]ethyl]guanidine Openeye Name: 2-[2-chloro-1-[3,5-dimethyl-4-[(2-nitrophenyl)methoxy]phenyl]ethyl]guanidine CAS Name: 2-[2-chloro-1-[3,5-dimethyl-4-[(2-nitrophenyl)methoxy]phenyl]ethyl]guanidine IUPAC Name: 2-[2-chloro-1-[3,5-dimethyl-4-[(2-nitrophenyl)methoxy]phenyl]ethyl]guanidine Traditional Name: 2-[2-chloro-1-[3,5-dimethyl-4-(2-nitrobenzyl)oxy-phenyl]ethyl]guanidine Formula: C18H21ClN4O3 MolecularWeight: 376.83734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=CC=CC=C2[N+](=O)[O-])C)C(CCl)N=C(N)N

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=CC=CC=C2[N+](=O)[O-])C)C(CCl)N=C(N)N

InChI

InChI=1S/C18H21ClN4O3/c1-11-7-14(15(9-19)22-18(20)21)8-12(2)17(11)26-10-13-5-3-4-6-16(13)23(24)25/h3-8,15H,9-10H2,1-2H3,(H4,20,21,22)