phenethyl-[(5,6,7-trimethoxy-2-phenyl-quinolin-3-yl)methyl]azanium

Systemtic Name: phenethyl-[(5,6,7-trimethoxy-2-phenyl-quinolin-3-yl)methyl]azanium Openeye Name: phenethyl-[(5,6,7-trimethoxy-2-phenyl-3-quinolyl)methyl]ammonium CAS Name: phenethyl-[(5,6,7-trimethoxy-2-phenyl-3-quinolinyl)methyl]ammonium IUPAC Name: phenethyl-[(5,6,7-trimethoxy-2-phenylquinolin-3-yl)methyl]azanium Traditional Name: phenethyl-[(5,6,7-trimethoxy-2-phenyl-3-quinolyl)methyl]ammonium Formula: C27H29N2O3+ MolecularWeight: 429.53076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C(=C1OC)OC)C[NH2+]CCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C(=C1OC)OC)C[NH2+]CCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O3/c1-30-24-17-23-22(26(31-2)27(24)32-3)16-21(25(29-23)20-12-8-5-9-13-20)18-28-15-14-19-10-6-4-7-11-19/h4-13,16-17,28H,14-15,18H2,1-3H3/p+1