7-chloranyl-5-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-amine

Systemtic Name: 7-chloranyl-5-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-amine Openeye Name: 7-chloro-5-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-amine CAS Name: 7-chloro-5-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-amine IUPAC Name: 7-chloro-5-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-amine Traditional Name: [7-chloro-5-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-yl]amine Formula: C16H14ClN3O MolecularWeight: 299.75486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NCC(=NC3=C2C=C(C=C3)Cl)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NCC(=NC3=C2C=C(C=C3)Cl)N

InChI

InChI=1S/C16H14ClN3O/c1-21-12-5-2-10(3-6-12)16-13-8-11(17)4-7-14(13)20-15(18)9-19-16/h2-8H,9H2,1H3,(H2,18,20)