(3-methoxyphenyl)methyl-methyl-[(4R)-7-oxidanylidene-1-(2-phenoxyethyl)azepan-4-yl]azanium

Systemtic Name: (3-methoxyphenyl)methyl-methyl-[(4R)-7-oxidanylidene-1-(2-phenoxyethyl)azepan-4-yl]azanium Openeye Name: (3-methoxyphenyl)methyl-methyl-[(4R)-7-oxo-1-(2-phenoxyethyl)azepan-4-yl]ammonium CAS Name: (3-methoxyphenyl)methyl-methyl-[(4R)-7-oxo-1-(2-phenoxyethyl)-4-azepanyl]ammonium IUPAC Name: (3-methoxyphenyl)methyl-methyl-[(4R)-7-oxo-1-(2-phenoxyethyl)azepan-4-yl]azanium Traditional Name: [(4R)-7-keto-1-(2-phenoxyethyl)azepan-4-yl]-m-anisyl-methyl-ammonium Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OC)C2CCC(=O)N(CC2)CCOC3=CC=CC=C3

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC)[C@@H]2CCC(=O)N(CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O3/c1-24(18-19-7-6-10-22(17-19)27-2)20-11-12-23(26)25(14-13-20)15-16-28-21-8-4-3-5-9-21/h3-10,17,20H,11-16,18H2,1-2H3/p+1/t20-/m1/s1