1-[(1S)-1-isocyanato-2-(3-methoxyphenyl)ethyl]-4-methyl-benzene

Systemtic Name: 1-[(1S)-1-isocyanato-2-(3-methoxyphenyl)ethyl]-4-methyl-benzene Openeye Name: 1-[(1S)-1-isocyanato-2-(3-methoxyphenyl)ethyl]-4-methyl-benzene CAS Name: 1-[(1S)-1-isocyanato-2-(3-methoxyphenyl)ethyl]-4-methylbenzene IUPAC Name: 1-[(1S)-1-isocyanato-2-(3-methoxyphenyl)ethyl]-4-methylbenzene Traditional Name: 1-[(1S)-1-isocyanato-2-(3-methoxyphenyl)ethyl]-4-methyl-benzene Formula: C17H17NO2 MolecularWeight: 267.32238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC2=CC(=CC=C2)OC)N=C=O

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CC2=CC(=CC=C2)OC)N=C=O

InChI

InChI=1S/C17H17NO2/c1-13-6-8-15(9-7-13)17(18-12-19)11-14-4-3-5-16(10-14)20-2/h3-10,17H,11H2,1-2H3/t17-/m0/s1