(1S)-N-[benzotriazol-1-yl-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-1-phenyl-ethanamine

Systemtic Name: (1S)-N-[benzotriazol-1-yl-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-1-phenyl-ethanamine Openeye Name: (1S)-N-[benzotriazol-1-yl-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-1-phenyl-ethanamine CAS Name: (1S)-N-[1-benzotriazolyl-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-1-phenylethanamine IUPAC Name: (1S)-N-[benzotriazol-1-yl-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-1-phenylethanamine Traditional Name: [benzotriazol-1-yl-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-[(1S)-1-phenylethyl]amine Formula: C20H24N4O2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(C2COC(O2)(C)C)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC([C@H]2COC(O2)(C)C)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H24N4O2/c1-14(15-9-5-4-6-10-15)21-19(18-13-25-20(2,3)26-18)24-17-12-8-7-11-16(17)22-23-24/h4-12,14,18-19,21H,13H2,1-3H3/t14-,18+,19?/m0/s1