N'-(2-chloranyl-4-nitro-phenyl)-N-[(4-ethoxy-3-methoxy-5-prop-2-enyl-phenyl)methyl]ethane-1,2-diamine

Systemtic Name: N'-(2-chloranyl-4-nitro-phenyl)-N-[(4-ethoxy-3-methoxy-5-prop-2-enyl-phenyl)methyl]ethane-1,2-diamine Openeye Name: N-[(3-allyl-4-ethoxy-5-methoxy-phenyl)methyl]-N'-(2-chloro-4-nitro-phenyl)ethane-1,2-diamine CAS Name: N'-(2-chloro-4-nitrophenyl)-N-[(4-ethoxy-3-methoxy-5-prop-2-enylphenyl)methyl]ethane-1,2-diamine IUPAC Name: N'-(2-chloro-4-nitrophenyl)-N-[(4-ethoxy-3-methoxy-5-prop-2-enylphenyl)methyl]ethane-1,2-diamine Traditional Name: (3-allyl-4-ethoxy-5-methoxy-benzyl)-[2-(2-chloro-4-nitro-anilino)ethyl]amine Formula: C21H26ClN3O4 MolecularWeight: 419.90184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1OC)CNCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)CC=C

Isomeric SMILES

CCOC1=C(C=C(C=C1OC)CNCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)CC=C

InChI

InChI=1S/C21H26ClN3O4/c1-4-6-16-11-15(12-20(28-3)21(16)29-5-2)14-23-9-10-24-19-8-7-17(25(26)27)13-18(19)22/h4,7-8,11-13,23-24H,1,5-6,9-10,14H2,2-3H3