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(3Z,5Z,7Z)-azocine; (1Z,4Z,6Z)-3-benzazocine

(3Z,5Z,7Z)-azocine; (1Z,4Z,6Z)-3-benzazocine

Systemtic Name:(3Z,5Z,7Z)-azocine; (1Z,4Z,6Z)-3-benzazocine
Openeye Name:(3Z,5Z,7Z)-azocine; (1Z,4Z,6Z)-3-benzazocine
CAS Name:(3Z,5Z,7Z)-azocine; (1Z,4Z,6Z)-3-benzazocine
IUPAC Name:(3Z,5Z,7Z)-azocine; (1Z,4Z,6Z)-3-benzazocine
Traditional Name:(3Z,5Z,7Z)-azocine; (1Z,4Z,6Z)-3-benzazocine
Formula: C46H44N6
MolecularWeight: 680.88176
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=CN=CC=C1.C1=CC=CN=CC=C1.C1=CC=CN=CC=C1.C1=CC=CN=CC=C1.C1=CC=CN=CC=C1.C1=CC2=CC=CN=CC=C2C=C1


Isomeric SMILES

C\1=C\C=C/N=C\C=C1.C\1=C\C=C/N=C\C=C1.C\1=C\C=C/N=C\C=C1.C\1=C\C=C/N=C\C=C1.C\1=C\C=C/N=C\C=C1.C1=C/C/2=C/C=C\N=C/C=C2/C=C1


InChI

InChI=1S/C11H9N.5C7H7N/c1-2-5-11-7-9-12-8-3-6-10(11)4-1;5*1-2-4-6-8-7-5-3-1/h1-9H;5*1-7H/b6-3?,8-3-,9-7?,10-6-,11-7-,12-8?,12-9?;5*2-1-,3-1?,4-2?,5-3-,6-4-,7-5?,8-6?,8-7?


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