(4-acetamidophenyl)methyl-[(3R)-1-cycloheptyl-5-oxidanylidene-pyrrolidin-3-yl]azanium

Systemtic Name: (4-acetamidophenyl)methyl-[(3R)-1-cycloheptyl-5-oxidanylidene-pyrrolidin-3-yl]azanium Openeye Name: (4-acetamidophenyl)methyl-[(3R)-1-cycloheptyl-5-oxo-pyrrolidin-3-yl]ammonium CAS Name: (4-acetamidophenyl)methyl-[(3R)-1-cycloheptyl-5-oxo-3-pyrrolidinyl]ammonium IUPAC Name: (4-acetamidophenyl)methyl-[(3R)-1-cycloheptyl-5-oxopyrrolidin-3-yl]azanium Traditional Name: (4-acetamidobenzyl)-[(3R)-1-cycloheptyl-5-keto-pyrrolidin-3-yl]ammonium Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C[NH2+]C2CC(=O)N(C2)C3CCCCCC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C[NH2+][C@@H]2CC(=O)N(C2)C3CCCCCC3

InChI

InChI=1S/C20H29N3O2/c1-15(24)22-17-10-8-16(9-11-17)13-21-18-12-20(25)23(14-18)19-6-4-2-3-5-7-19/h8-11,18-19,21H,2-7,12-14H2,1H3,(H,22,24)/p+1/t18-/m1/s1