(12S)-12-(benzotriazol-1-yl)-N,N-diethyl-12H-benzo[a]xanthen-9-amine

Systemtic Name: (12S)-12-(benzotriazol-1-yl)-N,N-diethyl-12H-benzo[a]xanthen-9-amine Openeye Name: (12S)-12-(benzotriazol-1-yl)-N,N-diethyl-12H-benzo[a]xanthen-9-amine CAS Name: (12S)-12-(1-benzotriazolyl)-N,N-diethyl-12H-benzo[a]xanthen-9-amine IUPAC Name: (12S)-12-(benzotriazol-1-yl)-N,N-diethyl-12H-benzo[a]xanthen-9-amine Traditional Name: [(12S)-12-(benzotriazol-1-yl)-12H-benzo[a]xanthen-9-yl]-diethyl-amine Formula: C27H24N4O MolecularWeight: 420.50566

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(C3=C(O2)C=CC4=CC=CC=C43)N5C6=CC=CC=C6N=N5

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)[C@@H](C3=C(O2)C=CC4=CC=CC=C43)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C27H24N4O/c1-3-30(4-2)19-14-15-21-25(17-19)32-24-16-13-18-9-5-6-10-20(18)26(24)27(21)31-23-12-8-7-11-22(23)28-29-31/h5-17,27H,3-4H2,1-2H3/t27-/m0/s1