(4-aminocarbonylphenyl)methyl-cyclopropyl-[2-[[(1R,2S)-2-methylcyclohexyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-aminocarbonylphenyl)methyl-cyclopropyl-[2-[[(1R,2S)-2-methylcyclohexyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-carbamoylphenyl)methyl-cyclopropyl-[2-[[(1R,2S)-2-methylcyclohexyl]amino]-2-oxo-ethyl]ammonium CAS Name: (4-carbamoylphenyl)methyl-cyclopropyl-[2-[[(1R,2S)-2-methylcyclohexyl]amino]-2-oxoethyl]ammonium IUPAC Name: (4-carbamoylphenyl)methyl-cyclopropyl-[2-[[(1R,2S)-2-methylcyclohexyl]amino]-2-oxoethyl]azanium Traditional Name: (4-carbamoylbenzyl)-cyclopropyl-[2-keto-2-[[(1R,2S)-2-methylcyclohexyl]amino]ethyl]ammonium Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C[NH+](CC2=CC=C(C=C2)C(=O)N)C3CC3

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=O)C[NH+](CC2=CC=C(C=C2)C(=O)N)C3CC3

InChI

InChI=1S/C20H29N3O2/c1-14-4-2-3-5-18(14)22-19(24)13-23(17-10-11-17)12-15-6-8-16(9-7-15)20(21)25/h6-9,14,17-18H,2-5,10-13H2,1H3,(H2,21,25)(H,22,24)/p+1/t14-,18+/m0/s1