(1S)-6-ethoxy-7-methoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: (1S)-6-ethoxy-7-methoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline Openeye Name: (1S)-6-ethoxy-7-methoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: (1S)-6-ethoxy-7-methoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline IUPAC Name: (1S)-6-ethoxy-7-methoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline Traditional Name: (1S)-6-ethoxy-7-methoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(NCCC2=C1)C3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C2[C@@H](NCCC2=C1)C3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H20N2O4/c1-3-24-17-10-12-7-8-19-18(15(12)11-16(17)23-2)13-5-4-6-14(9-13)20(21)22/h4-6,9-11,18-19H,3,7-8H2,1-2H3/t18-/m0/s1