[(1Z,4Z,6Z)-4-(diethylamino)-5-ethyl-2,3-benzodiazocin-1-yl]-phenyl-methanone

Systemtic Name: [(1Z,4Z,6Z)-4-(diethylamino)-5-ethyl-2,3-benzodiazocin-1-yl]-phenyl-methanone Openeye Name: [(1Z,4Z,6Z)-4-(diethylamino)-5-ethyl-2,3-benzodiazocin-1-yl]-phenyl-methanone CAS Name: [(1Z,4Z,6Z)-4-(diethylamino)-5-ethyl-2,3-benzodiazocin-1-yl]-phenylmethanone IUPAC Name: [(1Z,4Z,6Z)-4-(diethylamino)-5-ethyl-2,3-benzodiazocin-1-yl]-phenylmethanone Traditional Name: [(1Z,4Z,6Z)-4-(diethylamino)-5-ethyl-2,3-benzodiazocin-1-yl]-phenyl-methanone Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=NC(=C2C=CC=CC2=C1)C(=O)C3=CC=CC=C3)N(CC)CC

Isomeric SMILES

CC/C/1=C(/N=N/C(=C/2/C=CC=C\C2=C1)/C(=O)C3=CC=CC=C3)\N(CC)CC

InChI

InChI=1S/C23H25N3O/c1-4-17-16-19-14-10-11-15-20(19)21(22(27)18-12-8-7-9-13-18)24-25-23(17)26(5-2)6-3/h7-16H,4-6H2,1-3H3/b17-16?,19-16-,21-20-,23-17+,24-21?,25-23?,25-24?