3-(benzotriazol-1-yl)-N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]propanamide

Systemtic Name: 3-(benzotriazol-1-yl)-N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]propanamide Openeye Name: 3-(benzotriazol-1-yl)-N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]propanamide CAS Name: 3-(1-benzotriazolyl)-N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]propanamide IUPAC Name: 3-(benzotriazol-1-yl)-N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]propanamide Traditional Name: 3-(benzotriazol-1-yl)-N-[(Z)-[(2S)-2-methylcyclohexylidene]amino]propionamide Formula: C16H21N5O MolecularWeight: 299.37084

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1=NNC(=O)CCN2C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@H]\1CCCC/C1=N/NC(=O)CCN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H21N5O/c1-12-6-2-3-7-13(12)17-19-16(22)10-11-21-15-9-5-4-8-14(15)18-20-21/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,19,22)/b17-13-/t12-/m0/s1