4-[(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzenecarbonitrile Openeye Name: 4-[(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile CAS Name: 4-[(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile IUPAC Name: 4-[(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile Traditional Name: 4-[(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]benzonitrile Formula: C18H18N2O MolecularWeight: 278.34832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OCCCC2NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=CC2=C1OCCCC2NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H18N2O/c1-13-4-2-5-16-17(6-3-11-21-18(13)16)20-15-9-7-14(12-19)8-10-15/h2,4-5,7-10,17,20H,3,6,11H2,1H3