1-(azepan-1-ylmethyl)-4-[2,3-bis(chloranyl)phenyl]pyrrole-3-carbonitrile

Systemtic Name: 1-(azepan-1-ylmethyl)-4-[2,3-bis(chloranyl)phenyl]pyrrole-3-carbonitrile Openeye Name: 1-(azepan-1-ylmethyl)-4-(2,3-dichlorophenyl)pyrrole-3-carbonitrile CAS Name: 1-(1-azepanylmethyl)-4-(2,3-dichlorophenyl)-3-pyrrolecarbonitrile IUPAC Name: 1-(azepan-1-ylmethyl)-4-(2,3-dichlorophenyl)pyrrole-3-carbonitrile Traditional Name: 1-(azepan-1-ylmethyl)-4-(2,3-dichlorophenyl)pyrrole-3-carbonitrile Formula: C18H19Cl2N3 MolecularWeight: 348.26956

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CN2C=C(C(=C2)C3=C(C(=CC=C3)Cl)Cl)C#N

Isomeric SMILES

C1CCCN(CC1)CN2C=C(C(=C2)C3=C(C(=CC=C3)Cl)Cl)C#N

InChI

InChI=1S/C18H19Cl2N3/c19-17-7-5-6-15(18(17)20)16-12-23(11-14(16)10-21)13-22-8-3-1-2-4-9-22/h5-7,11-12H,1-4,8-9,13H2