2-[(3-methoxy-5-propan-2-yl-phenyl)methyl]-1-prop-2-enyl-azepane

Systemtic Name: 2-[(3-methoxy-5-propan-2-yl-phenyl)methyl]-1-prop-2-enyl-azepane Openeye Name: 1-allyl-2-[(3-isopropyl-5-methoxy-phenyl)methyl]azepane CAS Name: 2-[(3-methoxy-5-propan-2-ylphenyl)methyl]-1-prop-2-enylazepane IUPAC Name: 2-[(3-methoxy-5-propan-2-ylphenyl)methyl]-1-prop-2-enylazepane Traditional Name: 1-allyl-2-(3-isopropyl-5-methoxy-benzyl)azepane Formula: C20H31NO MolecularWeight: 301.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1)CC2CCCCCN2CC=C)OC

Isomeric SMILES

CC(C)C1=CC(=CC(=C1)CC2CCCCCN2CC=C)OC

InChI

InChI=1S/C20H31NO/c1-5-10-21-11-8-6-7-9-19(21)13-17-12-18(16(2)3)15-20(14-17)22-4/h5,12,14-16,19H,1,6-11,13H2,2-4H3