[2-chloranyl-4-(prop-2-enylamino)phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone

Systemtic Name: [2-chloranyl-4-(prop-2-enylamino)phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Openeye Name: [4-(allylamino)-2-chloro-phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone CAS Name: [2-chloro-4-(prop-2-enylamino)phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone IUPAC Name: [2-chloro-4-(prop-2-enylamino)phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Traditional Name: [4-(allylamino)-2-chloro-phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Formula: C20H21ClN2O MolecularWeight: 340.84654

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=CC(=C(C=C1)C(=O)N2CCCCC3=CC=CC=C32)Cl

Isomeric SMILES

C=CCNC1=CC(=C(C=C1)C(=O)N2CCCCC3=CC=CC=C32)Cl

InChI

InChI=1S/C20H21ClN2O/c1-2-12-22-16-10-11-17(18(21)14-16)20(24)23-13-6-5-8-15-7-3-4-9-19(15)23/h2-4,7,9-11,14,22H,1,5-6,8,12-13H2