5-azido-8-methoxy-2-naphthalen-1-ylsulfonyl-1,3,4,5-tetrahydro-2-benzazepine

Systemtic Name: 5-azido-8-methoxy-2-naphthalen-1-ylsulfonyl-1,3,4,5-tetrahydro-2-benzazepine Openeye Name: 5-azido-8-methoxy-2-(1-naphthylsulfonyl)-1,3,4,5-tetrahydro-2-benzazepine CAS Name: 5-azido-8-methoxy-2-(1-naphthalenylsulfonyl)-1,3,4,5-tetrahydro-2-benzazepine IUPAC Name: 5-azido-8-methoxy-2-naphthalen-1-ylsulfonyl-1,3,4,5-tetrahydro-2-benzazepine Traditional Name: 5-azido-8-methoxy-2-(1-naphthylsulfonyl)-1,3,4,5-tetrahydro-2-benzazepine Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(CCN(C2)S(=O)(=O)C3=CC=CC4=CC=CC=C43)N=[N+]=[N-]

Isomeric SMILES

COC1=CC2=C(C=C1)C(CCN(C2)S(=O)(=O)C3=CC=CC4=CC=CC=C43)N=[N+]=[N-]

InChI

InChI=1S/C21H20N4O3S/c1-28-17-9-10-18-16(13-17)14-25(12-11-20(18)23-24-22)29(26,27)21-8-4-6-15-5-2-3-7-19(15)21/h2-10,13,20H,11-12,14H2,1H3