3-(2-oxidanylideneazepan-1-yl)propyl-[(2R)-4-oxidanylidene-4-phenylazanyl-butan-2-yl]azanium

Systemtic Name: 3-(2-oxidanylideneazepan-1-yl)propyl-[(2R)-4-oxidanylidene-4-phenylazanyl-butan-2-yl]azanium Openeye Name: [(1R)-3-anilino-1-methyl-3-oxo-propyl]-[3-(2-oxoazepan-1-yl)propyl]ammonium CAS Name: [(2R)-4-anilino-4-oxobutan-2-yl]-[3-(2-oxo-1-azepanyl)propyl]ammonium IUPAC Name: [(2R)-4-anilino-4-oxobutan-2-yl]-[3-(2-oxoazepan-1-yl)propyl]azanium Traditional Name: [(1R)-3-anilino-3-keto-1-methyl-propyl]-[3-(2-ketoazepan-1-yl)propyl]ammonium Formula: C19H30N3O2+ MolecularWeight: 332.4604

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=CC=C1)[NH2+]CCCN2CCCCCC2=O

Isomeric SMILES

C[C@H](CC(=O)NC1=CC=CC=C1)[NH2+]CCCN2CCCCCC2=O

InChI

InChI=1S/C19H29N3O2/c1-16(15-18(23)21-17-9-4-2-5-10-17)20-12-8-14-22-13-7-3-6-11-19(22)24/h2,4-5,9-10,16,20H,3,6-8,11-15H2,1H3,(H,21,23)/p+1/t16-/m1/s1