6-chloranyl-4-methyl-N-[[(2S)-1-phenethylpyrrolidin-2-yl]methyl]-2,3-dihydro-1,4-benzoxazine-8-carboxamide

Systemtic Name: 6-chloranyl-4-methyl-N-[[(2S)-1-phenethylpyrrolidin-2-yl]methyl]-2,3-dihydro-1,4-benzoxazine-8-carboxamide Openeye Name: 6-chloro-4-methyl-N-[[(2S)-1-phenethylpyrrolidin-2-yl]methyl]-2,3-dihydro-1,4-benzoxazine-8-carboxamide CAS Name: 6-chloro-4-methyl-N-[[(2S)-1-phenethyl-2-pyrrolidinyl]methyl]-2,3-dihydro-1,4-benzoxazine-8-carboxamide IUPAC Name: 6-chloro-4-methyl-N-[[(2S)-1-phenethylpyrrolidin-2-yl]methyl]-2,3-dihydro-1,4-benzoxazine-8-carboxamide Traditional Name: 6-chloro-4-methyl-N-[[(2S)-1-phenethylpyrrolidin-2-yl]methyl]-2,3-dihydro-1,4-benzoxazine-8-carboxamide Formula: C23H28ClN3O2 MolecularWeight: 413.94032

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCOC2=C1C=C(C=C2C(=O)NCC3CCCN3CCC4=CC=CC=C4)Cl

Isomeric SMILES

CN1CCOC2=C1C=C(C=C2C(=O)NC[C@@H]3CCCN3CCC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H28ClN3O2/c1-26-12-13-29-22-20(14-18(24)15-21(22)26)23(28)25-16-19-8-5-10-27(19)11-9-17-6-3-2-4-7-17/h2-4,6-7,14-15,19H,5,8-13,16H2,1H3,(H,25,28)/t19-/m0/s1