N-(cyclopropylmethyl)-2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-propyl-ethanamide

Systemtic Name: N-(cyclopropylmethyl)-2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-propyl-ethanamide Openeye Name: N-(cyclopropylmethyl)-2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-propyl-acetamide CAS Name: N-(cyclopropylmethyl)-2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-propylacetamide IUPAC Name: N-(cyclopropylmethyl)-2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-propylacetamide Traditional Name: N-(cyclopropylmethyl)-2-[(2R)-3-keto-1-veratryl-piperazin-1-ium-2-yl]-N-propyl-acetamide Formula: C22H34N3O4+ MolecularWeight: 404.52306

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CC1)C(=O)CC2C(=O)NCC[NH+]2CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCN(CC1CC1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H33N3O4/c1-4-10-25(14-16-5-6-16)21(26)13-18-22(27)23-9-11-24(18)15-17-7-8-19(28-2)20(12-17)29-3/h7-8,12,16,18H,4-6,9-11,13-15H2,1-3H3,(H,23,27)/p+1/t18-/m1/s1