cyclopropylmethyl-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]azanium

Systemtic Name: cyclopropylmethyl-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]azanium Openeye Name: [2-[benzyl(2-thienylmethyl)amino]-2-oxo-ethyl]-(cyclopropylmethyl)ammonium CAS Name: cyclopropylmethyl-[2-oxo-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]ammonium IUPAC Name: [2-[benzyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-(cyclopropylmethyl)azanium Traditional Name: [2-[benzyl(2-thenyl)amino]-2-keto-ethyl]-(cyclopropylmethyl)ammonium Formula: C18H23N2OS+ MolecularWeight: 315.45302

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C[NH2+]CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3

Isomeric SMILES

C1CC1C[NH2+]CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3

InChI

InChI=1S/C18H22N2OS/c21-18(12-19-11-15-8-9-15)20(14-17-7-4-10-22-17)13-16-5-2-1-3-6-16/h1-7,10,15,19H,8-9,11-14H2/p+1