(6R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-4-(quinolin-6-ylmethyl)-1,4-diazepan-4-ium-2-one

Systemtic Name: (6R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-4-(quinolin-6-ylmethyl)-1,4-diazepan-4-ium-2-one Openeye Name: (6R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-4-(6-quinolylmethyl)-1,4-diazepan-4-ium-2-one CAS Name: (6R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-4-(6-quinolinylmethyl)-1,4-diazepan-4-ium-2-one IUPAC Name: (6R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-4-(quinolin-6-ylmethyl)-1,4-diazepan-4-ium-2-one Traditional Name: (6R)-6-methoxy-1-p-anisyl-4-(6-quinolylmethyl)-1,4-diazepan-4-ium-2-one Formula: C24H28N3O3+ MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

COC1C[NH+](CC(=O)N(C1)CC2=CC=C(C=C2)OC)CC3=CC4=C(C=C3)N=CC=C4

Isomeric SMILES

CO[C@H]1C[NH+](CC(=O)N(C1)CC2=CC=C(C=C2)OC)CC3=CC4=C(C=C3)N=CC=C4

InChI

InChI=1S/C24H27N3O3/c1-29-21-8-5-18(6-9-21)14-27-16-22(30-2)15-26(17-24(27)28)13-19-7-10-23-20(12-19)4-3-11-25-23/h3-12,22H,13-17H2,1-2H3/p+1/t22-/m0/s1