1-(2-chloranyl-5-nitro-phenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-(2-chloro-5-nitro-phenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(2-chloro-5-nitrophenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(2-chloro-5-nitrophenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(2-chloro-5-nitro-phenyl)-7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C18H19ClN2O4 MolecularWeight: 362.80746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CCNC(C2=C1)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)OC

Isomeric SMILES

CCOC1=C(C=C2CCNC(C2=C1)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C18H19ClN2O4/c1-3-25-17-10-13-11(8-16(17)24-2)6-7-20-18(13)14-9-12(21(22)23)4-5-15(14)19/h4-5,8-10,18,20H,3,6-7H2,1-2H3