2,2-dimethyl-4-[2-[(phenylmethyl)amino]ethylamino]-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-4-[2-[(phenylmethyl)amino]ethylamino]-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[2-(benzylamino)ethylamino]-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 2,2-dimethyl-4-[2-[(phenylmethyl)amino]ethylamino]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-[2-(benzylamino)ethylamino]-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[2-(benzylamino)ethylamino]-2,2-dimethyl-chroman-6-carbonitrile Formula: C21H25N3O MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=CC(=C2)C#N)NCCNCC3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=CC(=C2)C#N)NCCNCC3=CC=CC=C3)C

InChI

InChI=1S/C21H25N3O/c1-21(2)13-19(18-12-17(14-22)8-9-20(18)25-21)24-11-10-23-15-16-6-4-3-5-7-16/h3-9,12,19,23-24H,10-11,13,15H2,1-2H3