[2-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-2-oxidanylidene-ethyl]-ethyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-2-oxidanylidene-ethyl]-ethyl-(thiophen-2-ylmethyl)azanium Openeye Name: [2-[[(4S)-chroman-4-yl]amino]-2-oxo-ethyl]-ethyl-(2-thienylmethyl)ammonium CAS Name: [2-[[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]amino]-2-oxoethyl]-ethyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-2-oxoethyl]-ethyl-(thiophen-2-ylmethyl)azanium Traditional Name: [2-[[(4S)-chroman-4-yl]amino]-2-keto-ethyl]-ethyl-(2-thenyl)ammonium Formula: C18H23N2O2S+ MolecularWeight: 331.45242

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CS1)CC(=O)NC2CCOC3=CC=CC=C23

Isomeric SMILES

CC[NH+](CC1=CC=CS1)CC(=O)N[C@H]2CCOC3=CC=CC=C23

InChI

InChI=1S/C18H22N2O2S/c1-2-20(12-14-6-5-11-23-14)13-18(21)19-16-9-10-22-17-8-4-3-7-15(16)17/h3-8,11,16H,2,9-10,12-13H2,1H3,(H,19,21)/p+1/t16-/m0/s1